Information card for entry 4347353

Structure parameters

• Formula: C164 H111 B2 F49 Mo2 N8 P4
• Calculated formula: C164 H111 B2 F49 Mo2 N8 P4
• Title of publication: Terpyridine Molybdenum Dinitrogen Chemistry: Synthesis of Dinitrogen Complexes That Vary by Five Oxidation States.
• Authors of publication: Bezdek, Máté J; Guo, Sheng; Chirik, Paul J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 6
• Pages of publication: 3117 - 3127
• a: 13.3083 ± 0.0004 Å
• b: 16.7804 ± 0.0004 Å
• c: 34.3598 ± 0.0009 Å
• α: 85.775 ± 0.001°
• β: 82.71 ± 0.001°
• γ: 88.786 ± 0.001°
• Cell volume: 7589.9 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0377
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0845
• Weighted residual factors for all reflections included in the refinement: 0.0879
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No